Cordyheptapeptide E
| Internal ID | e233cc52-bc7b-42c1-82a6-f0b47b7c7210 |
| Taxonomy | Organic acids and derivatives > Carboxylic acids and derivatives > Amino acids, peptides, and analogues > Peptides > Oligopeptides |
| IUPAC Name | (3R,6S,9S,12S,15S,21S)-15-benzyl-9-[(2R)-butan-2-yl]-3,12-bis[(4-hydroxyphenyl)methyl]-4,13,19-trimethyl-6-(2-methylpropyl)-1,4,7,10,13,16,19-heptazabicyclo[19.3.0]tetracosane-2,5,8,11,14,17,20-heptone |
| SMILES (Canonical) | |
| SMILES (Isomeric) | |
| InChI | InChI=1S/C49H65N7O9/c1-8-31(4)43-45(61)51-37(25-30(2)3)46(62)55(7)41(28-34-18-22-36(58)23-19-34)49(65)56-24-12-15-39(56)48(64)53(5)29-42(59)50-38(26-32-13-10-9-11-14-32)47(63)54(6)40(44(60)52-43)27-33-16-20-35(57)21-17-33/h9-11,13-14,16-23,30-31,37-41,43,57-58H,8,12,15,24-29H2,1-7H3,(H,50,59)(H,51,61)(H,52,60)/t31-,37+,38+,39+,40+,41-,43+/m1/s1 |
| InChI Key | RSKSPMHQQIYPNU-CWAWLLILSA-N |
| Popularity | 2 references in papers |
| Molecular Formula | C49H65N7O9 |
| Molecular Weight | 896.10 g/mol |
| Exact Mass | 895.48437668 g/mol |
| Topological Polar Surface Area (TPSA) | 209.00 Ų |
| XlogP | 5.40 |
| CHEMBL2063005 |
| Target | Value | Probability (raw) | Probability (%) |
|---|---|---|---|
| No predicted properties yet! | |||
Proven Targets:
| CHEMBL ID | UniProt ID | Name | Min activity | Assay type | Source |
|---|---|---|---|---|---|
| No proven targets yet! | |||||
Predicted Targets (via Super-PRED):
| CHEMBL ID | UniProt ID | Name | Probability | Model accuracy |
|---|---|---|---|---|
| CHEMBL2581 | P07339 | Cathepsin D | 99.95% | 98.95% |
| CHEMBL3251 | P19838 | Nuclear factor NF-kappa-B p105 subunit | 98.12% | 96.09% |
| CHEMBL3108638 | O15164 | Transcription intermediary factor 1-alpha | 96.42% | 95.56% |
| CHEMBL4261 | Q16665 | Hypoxia-inducible factor 1 alpha | 95.28% | 85.14% |
| CHEMBL2693 | Q9UIQ6 | Cystinyl aminopeptidase | 94.89% | 97.64% |
| CHEMBL2069156 | Q14145 | Kelch-like ECH-associated protein 1 | 94.52% | 82.38% |
| CHEMBL5103 | Q969S8 | Histone deacetylase 10 | 93.68% | 90.08% |
| CHEMBL5966 | P55899 | IgG receptor FcRn large subunit p51 | 91.97% | 90.93% |
| CHEMBL3524 | P56524 | Histone deacetylase 4 | 90.50% | 92.97% |
| CHEMBL226 | P30542 | Adenosine A1 receptor | 90.35% | 95.93% |
| CHEMBL5608 | Q16288 | NT-3 growth factor receptor | 90.34% | 95.89% |
| CHEMBL217 | P14416 | Dopamine D2 receptor | 89.89% | 95.62% |
| CHEMBL3807 | P17706 | T-cell protein-tyrosine phosphatase | 89.66% | 93.00% |
| CHEMBL4203 | Q9HAZ1 | Dual specificity protein kinase CLK4 | 89.40% | 94.45% |
| CHEMBL253 | P34972 | Cannabinoid CB2 receptor | 88.55% | 97.25% |
| CHEMBL2095172 | P14867 | GABA-A receptor; alpha-1/beta-2/gamma-2 | 87.96% | 92.67% |
| CHEMBL1907603 | Q05586 | Glutamate NMDA receptor; GRIN1/GRIN2B | 87.32% | 95.89% |
| CHEMBL1293249 | Q13887 | Kruppel-like factor 5 | 86.31% | 86.33% |
| CHEMBL3137262 | O60341 | LSD1/CoREST complex | 86.31% | 97.09% |
| CHEMBL1902 | P62942 | FK506-binding protein 1A | 84.75% | 97.05% |
| CHEMBL5203 | P33316 | dUTP pyrophosphatase | 84.19% | 99.18% |
| CHEMBL333 | P08253 | Matrix metalloproteinase-2 | 83.75% | 96.31% |
| CHEMBL4208 | P20618 | Proteasome component C5 | 82.68% | 90.00% |
| CHEMBL5845 | P23415 | Glycine receptor subunit alpha-1 | 82.31% | 90.71% |
| CHEMBL2288 | Q13526 | Peptidyl-prolyl cis-trans isomerase NIMA-interacting 1 | 81.86% | 91.71% |
| CHEMBL4523377 | Q86WV6 | Stimulator of interferon genes protein | 81.85% | 95.48% |
| CHEMBL3024 | P53350 | Serine/threonine-protein kinase PLK1 | 81.28% | 97.43% |
| CHEMBL206 | P03372 | Estrogen receptor alpha | 80.70% | 97.64% |
Below are displayed all the plants proven (via scientific papers) to contain this
compound!
To see more specific details click the taxa you are interested in.
To see more specific details click the taxa you are interested in.
| There are no matching plants. |
| PubChem | 60155155 |
| LOTUS | LTS0133946 |
| wikiData | Q77310150 |